6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid

C11H12N2O4 — CID 130229153

IUPAC6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESCC(O)COc1ccc2c(C(=O)O)cnn2c1
InChIInChI=1S/C11H12N2O4/c1-7(14)6-17-8-2-3-10-9(11(15)16)4-12-13(10)5-8/h2-5,7,14H,6H2,1H3,(H,15,16)
InChIKeyOGXBJUWDOUFSHQ-UHFFFAOYSA-N
MW236.23 g/mol
LogP0.79
Rot. Bonds4

About 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid

6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid (PubChem CID 130229153) has the molecular formula C11H12N2O4 and a molecular weight of 236.23 g/mol. Its IUPAC name is 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid
PubChem CID130229153
Molecular FormulaC11H12N2O4
Molecular Weight236.23 g/mol
Exact Mass236.08
IUPAC Name6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid
SMILESCC(O)COc1ccc2c(C(=O)O)cnn2c1
InChIInChI=1S/C11H12N2O4/c1-7(14)6-17-8-2-3-10-9(11(15)16)4-12-13(10)5-8/h2-5,7,14H,6H2,1H3,(H,15,16)
InChIKeyOGXBJUWDOUFSHQ-UHFFFAOYSA-N
XLogP0.79
TPSA84.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid?
The IUPAC name of 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid (CID 130229153) is 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid?
The canonical SMILES for 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid is CC(O)COc1ccc2c(C(=O)O)cnn2c1.
What is the InChIKey of 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid?
The InChIKey is OGXBJUWDOUFSHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O4/c1-7(14)6-17-8-2-3-10-9(11(15)16)4-12-13(10)5-8/h2-5,7,14H,6H2,1H3,(H,15,16).
What are the key properties of 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid?
6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid has a molecular weight of 236.23 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxypropoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 130229153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).